SCHEMBL4139656

SCHEMBL4139656

CC(C)C[C@@H](C(N)=O)N(CCCCNS(=O)(=O)c1ccc(Cl)cc1Cl)C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 15/20 0.40
GAA P10253 1/20 0.39
CCR1 P32246 1/20 0.37
AAK1 Q2M2I8 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4135952 0.86 TRPV4 (0.41) TRPV4AAK1
SCHEMBL5430576 0.84 RAB9A (0.38) TRPV4GAAAAK1
SCHEMBL4142748 0.82 TRPV4 (0.49) TRPV4GAA
SCHEMBL4135576 0.81 TP53 (0.43) TRPV4GAA
SCHEMBL4127509 0.81 TRPV4 (0.41) TRPV4GAA
SCHEMBL4135548 0.78 ADAM17 (0.38) TRPV4AAK1
Hydrochloric Acid SCHEMBL4136144 0.77 CCR1 (0.45) TRPV4GAACCR1CNR2
SCHEMBL13872494 0.77 AAK1 (0.43) TRPV4GAACCR1AAK1CNR1
SCHEMBL4133641 0.77 CCR1 (0.40) TRPV4CCR1
SCHEMBL4141257 0.77 CCR1 (0.41) TRPV4GAACCR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof SMITHKLINE BEECHAM CORPORATION 2009-04-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof TRPV4, TRPC4, TRPV1 TRPV4 1/4885GAA 3715/4885CCR1 766/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.